2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-3-[(4-fluorophenyl)methyl]quinazolin-4-one

Systemtic Name: 2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-3-[(4-fluorophenyl)methyl]quinazolin-4-one Openeye Name: 2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-3-[(4-fluorophenyl)methyl]quinazolin-4-one CAS Name: 2-[2-(4-ethoxyphenoxy)ethylthio]-3-[(4-fluorophenyl)methyl]-4-quinazolinone IUPAC Name: 2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-3-[(4-fluorophenyl)methyl]quinazolin-4-one Traditional Name: 2-[2-(4-ethoxyphenoxy)ethylthio]-3-(4-fluorobenzyl)quinazolin-4-one Formula: C25H23FN2O3S MolecularWeight: 450.525123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)F

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)F

InChI

InChI=1S/C25H23FN2O3S/c1-2-30-20-11-13-21(14-12-20)31-15-16-32-25-27-23-6-4-3-5-22(23)24(29)28(25)17-18-7-9-19(26)10-8-18/h3-14H,2,15-17H2,1H3